On the public citation graph

Theoretical Study of Gas-Phase Reactions of Fe(CO)5 with OH- and Their Relevance for the Water Gas Shift Reaction

0 signed · 169 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.

Claim with ORCID

Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.

See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/anie.198207113openalex-snapshot

Building Bridges Between Inorganic and Organic Chemistry (Nobel Lecture)

inferredcites →https://doi.org/10.1002/cber.19180510230openalex-snapshot

Darstellung von Formaldehyd und Methylalkohol aus Formiaten

inferredcites →https://doi.org/10.1002/cber.19640970628openalex-snapshot

Über kationische Kohlenoxidkomplexe, IV. Carboalkoxocarbonyle von Mangan und Rhenium

inferredcites →https://doi.org/10.1002/cber.19660990411openalex-snapshot

Über kationische Kohlenoxidkomplexe, VII. Reaktionsweisen von Rhenium (I)‐Kohlenoxidkomplexen und neue Anschauungen über den Mechanismus der Basenreaktion von Metallcarbonylen

inferredcites →https://doi.org/10.1002/ijch.197600044openalex-snapshot

Oxygen Exchange Reactions of Cationic Carbonyl Derivatives of Manganese and Rhenium with H218O and Related Processes

inferredcites →https://doi.org/10.1002/qua.560140503openalex-snapshot

Electron correlation theories and their application to the study of simple reaction potential surfaces

inferredcites →https://doi.org/10.1002/qua.560140504openalex-snapshot

Many‐body perturbation theory, coupled‐pair many‐electron theory, and the importance of quadruple excitations for the correlation problem

inferredcites →https://doi.org/10.1002/zaac.19332120204openalex-snapshot

Über Metallcarbonyle. XIX. Über Eisencarbonylwasserstoff

inferredcites →https://doi.org/10.1002/zaac.19663430314openalex-snapshot

Beitrag zur Untersuchung der thermischen Zersetzung von Kobalt‐carbonylwasserstoff

inferredcites →https://doi.org/10.1007/bf00533485openalex-snapshot

The influence of polarization functions on molecular orbital hydrogenation energies

inferredcites →https://doi.org/10.1007/bf00552671openalex-snapshot

Ab-initio SCF potential energy surfaces for the nucleophilic attack of hydride on coordinated carbon monoxide

inferredcites →https://doi.org/10.1016/0009-2614(77)80489-2openalex-snapshot

Orientational and site selectivity in low temperature infrared laser-induced photochemistry

inferredcites →https://doi.org/10.1016/0009-2614(80)80628-2openalex-snapshot

The isomers of silacyclopropane

inferredcites →https://doi.org/10.1016/0016-0032(51)90959-3openalex-snapshot

The Fischer-Tropsch and related syntheses

inferredcites →https://doi.org/10.1016/0022-2860(74)85017-9openalex-snapshot

A re-evaluation of the molecular structure of iron pentacarbonyl

inferredcites →https://doi.org/10.1016/0040-4039(70)80086-7openalex-snapshot

Formamides from carbon dioxide, amines and hydrogen in the presence of metal complexes

inferredcites →https://doi.org/10.1016/s0010-8545(96)01301-xopenalex-snapshot

Application of transition metals in hydroformylation. Annual survey covering the year 1995

inferredcites →https://doi.org/10.1016/s0022-328x(00)80107-2openalex-snapshot

Kinetics and mechanism of the decomposition of cobalt tetracarbonyl hydride to dicobalt octacarbonyl and hydrogen

inferredcites →https://doi.org/10.1016/s0022-328x(00)84536-2openalex-snapshot

Hydrido(phenyl)- and hydrido(methyl)-platinum(II) complexes via thermally unstable methoxo and formato complexes

inferredcites →https://doi.org/10.1016/s0022-328x(97)00383-5openalex-snapshot

The azamacrocyclic derivatives of H4Ru4(CO)12 and their reactivity with CO and catalytic activity in the methanol carbonylation and in the water—gas shift reaction

inferredcites →https://doi.org/10.1016/s0140-6701(99)98224-3openalex-snapshot

99/02455 Mechanochemical catalysts in conversions of C1 molecules (syntheses of methanol and methyl formate, Fischer—Tropsch synthesis, and water-gas shift reaction)

inferredcites →https://doi.org/10.1016/s0277-5387(98)00032-1openalex-snapshot

The synthesis characterisation of some water solublerutheniumosmium clustersa preliminary study of their useas catalysts in the water gas shift reaction

inferredcites →https://doi.org/10.1016/s0277-5387(98)00101-6openalex-snapshot

In situ infrared spectroelectrochemical studies of [Ru6C(CO)17][Ru6C(CO)16]2−: the redox induced conversion of carbonmonoxide to carbon dioxide

inferredcites →https://doi.org/10.1021/ar00062a001openalex-snapshot

The water gas shift reaction: homogeneous catalysis by ruthenium and other metal carbonyls

inferredcites →https://doi.org/10.1021/ar00143a004openalex-snapshot

Shedding light on organometallic reactions: the characterization of tetracarbonyliron (Fe(CO)4), a prototypical reaction intermediate

inferredcites →https://doi.org/10.1021/ba-1979-0173.ch008openalex-snapshot

Homogeneous Catalysis of the Water Gas Shift Reaction by Metal Carbonyls

inferredcites →https://doi.org/10.1021/ba-1979-0173.ch009openalex-snapshot

Homogeneous Catalysis of the Water Gas Shift Reaction: Pentacarbonyliron and the Metal Hexacarbonyls as Active Catalyst Precursors

inferredcites →https://doi.org/10.1021/ba-1979-0173.ch010openalex-snapshot

Oxygen-Exchange and Ligand Substitution Reactions in Cr(CO)6 and μ-H[Cr(CO)5]2-, and the Water Gas Shift Reaction

inferredcites →https://doi.org/10.1021/cr00005a001openalex-snapshot

Approximate density functional theory as a practical tool in molecular energetics and dynamics

inferredcites →https://doi.org/10.1021/cr00065a002openalex-snapshot

The transition-metal-hydrogen bond

inferredcites →https://doi.org/10.1021/i260045a003openalex-snapshot

Removal of Sulfur Dioxide from Stack Gases by Catalytic Reduction to Elemental Sulfur with Carbon Monoxide

inferredcites →https://doi.org/10.1021/i360049a016openalex-snapshot

Ammonia Formation in the Catalytic Reduction of Nitric Oxide. III. The Role of Water Gas Shift, Reduction by Hydrocarbons, and Steam Reforming

inferredcites →https://doi.org/10.1021/ic00074a022openalex-snapshot

Molecular orbital analysis of the intermediates and products generated by the photooxidation of iron pentacarbonyl

inferredcites →https://doi.org/10.1021/ic00134a097openalex-snapshot

Kinetics of carbon monoxide activation: reactions of methoxide and of hydroxide with ruthenium and iron carbonyls

inferredcites →https://doi.org/10.1021/ic00136a001openalex-snapshot

Rhodium A-frame complexes with small-molecular bridgeheads. Synthesis and structure of [Rh2(.mu.-H)(.mu.-CO)(CO)2(PPh2CH2PPh2)2](p-CH3C6H4SO3).2THF and catalytic properties

inferredcites →https://doi.org/10.1021/ic50087a043openalex-snapshot

Chemistry of metal hydrides. VIII. Hydrolysis of transition metal alkoxycarbonyls and a kinetic study of the hydrolysis of trans-[PtCl(CO)(R3P)2]BF4

inferredcites →https://doi.org/10.1021/ic50147a021openalex-snapshot

Bonding capabilities of transition metal carbonyl fragments

inferredcites →https://doi.org/10.1021/ic50189a070openalex-snapshot

Preparation of oxygen-18-labeled derivatives of [Mn(CO)3(diphos)H] via reaction of [Mn(CO)4(diphos)][PF6] with water (oxygen-18) in the presence of triethylamine. Decarboxylation of a [Mn(COOH)] intermediate

inferredcites →https://doi.org/10.1021/ic50204a061openalex-snapshot

Synthesis and characterization of a hydroxycarbonyl complex of platinum: trans-[PtCl(COOH)(PEt3)2]

inferredcites →https://doi.org/10.1021/ic970897+openalex-snapshot

Is CO a Special Ligand in Organometallic Chemistry? Theoretical Investigation of AB, Fe(CO)4AB, and Fe(AB)5 (AB = N2, CO, BF, SiO)

inferredcites →https://doi.org/10.1021/j100257a006openalex-snapshot

The effect of electron correlation on the metal-ligand interaction in iron pentacarbonyl (Fe(CO)5)

inferredcites →https://doi.org/10.1021/ja00023a024openalex-snapshot

Gas-phase acidities of pentacarbonyl manganese, iron, and cobalt hydrides, (CO)5MnH, (CO)4FeH2, and (CO)4CoH

inferredcites →https://doi.org/10.1021/ja00054a048openalex-snapshot

Energetics and mechanism of the thermal decarboxylation of tetracarbonyl(carboxy)ferrate(1-) in the gas phase

inferredcites →https://doi.org/10.1021/ja00106a056openalex-snapshot

A Reassessment of the First Metal-Carbonyl Dissociation Energy in M(CO)4 (M = Ni, Pd, Pt), M(CO)5 (M = Fe, Ru, Os), and M(CO)6 (M = Cr, Mo, W) by a Quasirelativistic Density Functional Method

inferredcites →https://doi.org/10.1021/ja00158a022openalex-snapshot

A transient infrared spectroscopy study of coordinatively unsaturated osmium carbonyl compounds

inferredcites →https://doi.org/10.1021/ja00191a009openalex-snapshot

A transient infrared spectroscopy study of coordinatively unsaturated ruthenium carbonyls

inferredcites →https://doi.org/10.1021/ja00240a020openalex-snapshot

Ab initio study of the unimolecular pyrolysis mechanisms of formic acid: additional comments based on refined calculations

inferredcites →https://doi.org/10.1021/ja00263a004openalex-snapshot

Ab initio quantum-chemical study of the unimolecular pyrolysis mechanisms of formic acid

inferredcites →https://doi.org/10.1021/ja00275a024openalex-snapshot

Gas-phase nucleophilic addition reactions of negative ions with transition-metal carbonyls

inferredcites →https://doi.org/10.1021/ja00283a008openalex-snapshot

Gas-phase nucleophilic addition reactions of negative ions with transition-metal carbonyls. 2. Solvated anions

inferredcites →https://doi.org/10.1021/ja00292a023openalex-snapshot

Kinetics of the chromium hexacarbonyl and tungsten hexacarbonyl catalyzed water gas shift reaction: photoinitiated formate decomposition as a probe of the catalytic cycle

inferredcites →https://doi.org/10.1021/ja00294a027openalex-snapshot

Nucleophilic activation of coordinated carbon monoxide. 2. Reactions of the mononuclear complexes M(CO)5 [M = Fe, Ru, or Os] with hydroxide and with methoxide

inferredcites →https://doi.org/10.1021/ja00326a004openalex-snapshot

Organometallic bond dissociation energies: laser pyrolysis of iron pentacarbonyl, chromium hexacarbonyl, molybdenum hexacarbonyl, and tungsten hexacarbonyl

inferredcites →https://doi.org/10.1021/ja00332a001openalex-snapshot

Formation and reactivity of the iron carboxylic acid anion Fe(CO)4COOH- in the gas phase. Implications for the iron pentacarbonyl-catalyzed water-gas shift reaction

inferredcites →https://doi.org/10.1021/ja00365a013openalex-snapshot

Olefin rearrangement resulting from the gas-phase krypton fluoride laser photolysis of chromium hexacarbonyl

inferredcites →https://doi.org/10.1021/ja00366a020openalex-snapshot

Reactions of iron pentacarbonyl and dihydrogen tetracarbonylferrate related to the water-gas shift reaction

inferredcites →https://doi.org/10.1021/ja00399a047openalex-snapshot

Matrix photolysis of tetracarbonyldihydridoiron. Evidence for oxidative addition of dihydrogen on tetracarbonyliron

inferredcites →https://doi.org/10.1021/ja00400a035openalex-snapshot

Homogeneous catalysis of the water gas shift reaction with the use of Group 6 transition metal carbonyls: hexacarbonylchromium, hexacarbonylmolybdenum, and hexacarbonyltungsten

inferredcites →https://doi.org/10.1021/ja00401a055openalex-snapshot

Facile reduction of carbon dioxide by anionic Group 6b metal hydrides. Chemistry relevant to catalysis of the water-gas shift reaction

inferredcites →https://doi.org/10.1021/ja00411a050openalex-snapshot

Iron and ruthenium carbonyl catalyzed reductive carbonylation of nitro compounds by sodium methoxide. A significant effect of the metal on the reaction course

inferredcites →https://doi.org/10.1021/ja00443a049openalex-snapshot

Homogeneous catalysis by ruthenium carbonyl in alkaline solution: the water gas shift reaction

inferredcites →https://doi.org/10.1021/ja00443a050openalex-snapshot

Conjugate addition of vinylcopper complexes derived from addition of alkylcopper complexes to acetylenes. A stereospecific synthesis of trisubstituted olefins

inferredcites →https://doi.org/10.1021/ja00450a062openalex-snapshot

Homogeneous catalysis of the water gas shift reaction using rhodium carbonyl iodide

inferredcites →https://doi.org/10.1021/ja00456a033openalex-snapshot

Oxygen exchange reactions of water (oxygen-18) with hexacarbonyl cations of manganese and rhenium

inferredcites →https://doi.org/10.1021/ja00461a011openalex-snapshot

Molecular structure of the gaseous metal carbonyl hydrides of manganese, iron, and cobalt

inferredcites →https://doi.org/10.1021/ja00465a028openalex-snapshot

The infrared laser induced isomerization of iron tetracarbonyl. The first non-Berry pseudorotation

inferredcites →https://doi.org/10.1021/ja00467a038openalex-snapshot

Reductions with carbon monoxide and water in place of hydrogen. 1. Hydroformylation reaction and water gas shift reaction

inferredcites →https://doi.org/10.1021/ja00480a055openalex-snapshot

Complete kinetic analysis of thermal stereomutations of (+)-(1S,2S,3S)-r-1-cyano-t-2-phenyl-1,c-3-dideuteriocyclopropane

inferredcites →https://doi.org/10.1021/ja00480a075openalex-snapshot

Catalytic reductions using carbon monoxide and water in place of hydrogen. 2. Reduction of aromatic nitro compounds to amines

inferredcites →https://doi.org/10.1021/ja00482a047openalex-snapshot

Homogeneous catalysis of the water gas shift reaction by mixed-metal (iron/ruthenium) catalysts

inferredcites →https://doi.org/10.1021/ja00488a031openalex-snapshot

Applications of the water-gas shift reaction. Hydroformylation and hydrohydroxymethylation with carbon monoxide and water

inferredcites →https://doi.org/10.1021/ja00488a057openalex-snapshot

Applications of the water-gas shift reaction. 2. Catalytic exchange of deuterium for hydrogen at saturated carbon

inferredcites →https://doi.org/10.1021/ja00490a034openalex-snapshot

An examination of the reductive-elimination reaction. Chemistry of XYCo[P(OR)3]z+ complexes

inferredcites →https://doi.org/10.1021/ja00500a060openalex-snapshot

Chemical properties of metallocarboxylic acids of transition metals

inferredcites →https://doi.org/10.1021/ja00509a029openalex-snapshot

Hydration and reduction of carbon dioxide by rhodium hydride compounds. Preparation and reactions of rhodium bicarbonate and formate complexes, and the molecular structure of RhH2(O2COH)(P(i-Pr)3)2

inferredcites →https://doi.org/10.1021/ja00514a011openalex-snapshot

Homogeneous catalysis of the water gas shift reaction by ruthenium and other metal carbonyls. Studies in alkaline solutions

inferredcites →https://doi.org/10.1021/ja00523a019openalex-snapshot

Mechanistic studies of the homogeneous catalysis of the water gas shift reaction by rhodium carbonyl iodide

inferredcites →https://doi.org/10.1021/ja00523a020openalex-snapshot

Homogeneous catalysis of the water gas shift reaction using iron pentacarbonyl

inferredcites →https://doi.org/10.1021/ja00530a061openalex-snapshot

Molecular A frames. Synthesis from binuclear rhodium(0) precursors and catalytic activity in the water gas shift reaction and alkyne hydrogenation

inferredcites →https://doi.org/10.1021/ja00773a043openalex-snapshot

Oxidation of cobalt(I) carbonyl complexes and cobalt(I)-catalyzed oxidation of carbon monoxide

inferredcites →https://doi.org/10.1021/ja00850a001openalex-snapshot

Photochemistry of the Group 6 hexacarbonyls in low-temperature matrices. III. Interaction of the pentacarbonyls with noble gases and other matrices

inferredcites →https://doi.org/10.1021/ja01034a015openalex-snapshot

Chemistry of metal hydrides. V. Preparation of platinum hydrides from[PtX(CO)R3)2] and [PtX(COOR)(Ph3P)2]

inferredcites →https://doi.org/10.1021/ja01177a027openalex-snapshot

The Acid Properties of Iron Tetracarbonyl Hydride

inferredcites →https://doi.org/10.1021/ja01466a062openalex-snapshot

OXIDATION OF CARBON MONOXIDE BY METAL IONS

inferredcites →https://doi.org/10.1021/ja01580a004openalex-snapshot

Binuclear Iron Carbonyls and Their Significance as Catalytic Intermediates1

inferredcites →https://doi.org/10.1021/ja9741584openalex-snapshot

Molecular Structure of Tetracarbonyldihydroiron: Microwave Measurements and Density Functional Theory Calculations

inferredcites →https://doi.org/10.1021/ja981197mopenalex-snapshot

The First Carbonyl Bond Dissociation Energies of M(CO)5and M(CO)4(C2H2) (M = Fe, Ru, and Os): The Role of the Acetylene Ligand from a Density Functional Perspective

inferredcites →https://doi.org/10.1021/om00001a058openalex-snapshot

Structures and Bond Energies of the Transition-Metal Carbonyls M(CO)5 (M = Fe, Ru, Os) and M(CO)4 (M = Ni, Pd, Pt)

inferredcites →https://doi.org/10.1021/om00005a030openalex-snapshot

Oxidative Insertion as Frontside SN2 Substitution: A Theoretical Study of the Model Reaction System Pd + CH3Cl

inferredcites →https://doi.org/10.1021/om00028a082openalex-snapshot

Nickel carbonyl [Ni(CO)4] and iron carbonyl [Fe(CO)5]: molecular structures in the solid state

inferredcites →https://doi.org/10.1021/om00067a016openalex-snapshot

Hydrido and hydroxycarbonyl compounds of the carbonyl(.eta.-cyclopentadienyl)nitrosylrhenium group

inferredcites →https://doi.org/10.1021/om00072a026openalex-snapshot

Anionic Group 6B metal carbonyl hydrides and formates. Chemistry relevant to catalysis of the water-gas shift reaction by Group 6B metal hexacarbonyls

inferredcites →https://doi.org/10.1021/om00072a039openalex-snapshot

Role of homogeneous formate complexes in the water gas shift reaction catalyzed by the Group VI metal carbonyls

inferredcites →https://doi.org/10.1039/c39770000841openalex-snapshot

Magnetic circular dichroism evidence for the paramagnetism of tetracarbonyliron(0): low-temperature matrix studies

inferredcites →https://doi.org/10.1039/c39800000529openalex-snapshot

Sulphur-tolerant homogeneous catalysts for the water gas shift reaction

inferredcites →https://doi.org/10.1039/f29747001599openalex-snapshot

Calculation of the geometries of binary transition metal carbonyl and dinitrogen complexes

inferredcites →https://doi.org/10.1063/1.1674902openalex-snapshot

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

inferredcites →https://doi.org/10.1063/1.1677527openalex-snapshot

Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic Molecules

inferredcites →https://doi.org/10.1063/1.1678529openalex-snapshot

Potential Constants of Iron Pentacarbonyl from Vibrational Spectra of Isotopic Species

inferredcites →https://doi.org/10.1063/1.440841openalex-snapshot

Ultraviolet laser photolysis: Primary photochemistry of Fe(CO)5 in PF3

inferredcites →https://doi.org/10.1063/1.442770openalex-snapshot

The EPR spectrum of a single crystal of chromium hexacarbonyl doped with Fe(CO)5

inferredcites →https://doi.org/10.1063/1.443164openalex-snapshot

A full coupled-cluster singles and doubles model: The inclusion of disconnected triples

inferredcites →https://doi.org/10.1063/1.448975openalex-snapshot

Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals

inferredcites →https://doi.org/10.1063/1.452353openalex-snapshot

The full CCSDT model for molecular electronic structure

inferredcites →https://doi.org/10.1063/1.459924openalex-snapshot

An ab initio study of Fe(CO)n, n=1,5, and Cr(CO)6

inferredcites →https://doi.org/10.1063/1.464913openalex-snapshot

Density-functional thermochemistry. III. The role of exact exchange

inferredcites →https://doi.org/10.1063/1.478045openalex-snapshot

Density functional study of the Fe–CO bond dissociation energies of Fe(CO)5

inferredcites →https://doi.org/10.1080/00268977400100171openalex-snapshot

Accuracy of AH n equilibrium geometries by single determinant molecular orbital theory

inferredcites →https://doi.org/10.1139/v92-085openalex-snapshot

Relativistic compact effective potentials and efficient, shared-exponent basis sets for the third-, fourth-, and fifth-row atoms

inferredcites →https://doi.org/10.1246/cl.1994.1391openalex-snapshot

Reverse Water-Gas Shift Reaction Catalyzed by Ruthenium Cluster Anions

inferredcites →https://doi.org/10.1515/znb-1961-1101openalex-snapshot

Über kationische Kohlenoxyd-Komplexe, I Hexacarbonylrhenium (I)-Salze

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.2139/ssrn.4682333openalex-extracted

inferred← citeshttps://doi.org/10.1002/0470862106.ia635openalex-snapshot

Electronic Structure Calculations: Metal Carbonyls

inferred← citeshttps://doi.org/10.1002/1097-461x(2001)81:2<162::aid-qua8>3.0.co;2-aopenalex-snapshot

Density functional theory study of the structures and stabilities of CuO and CuO3

inferred← citeshttps://doi.org/10.1002/1099-0682(200106)2001:6<1441::aid-ejic1441>3.0.co;2-gopenalex-snapshot

On the Relevance of Mono- and Dinuclear Iron Carbonyl Complexes to the Fixation and Stepwise Hydrogenation of N2

inferred← citeshttps://doi.org/10.1002/9781119951438.eibc0397openalex-snapshot

Electronic Structure Calculations: Metal Carbonyls

inferred← citeshttps://doi.org/10.1002/9783527651733.ch38openalex-snapshot

Water‐Gas Shift Reaction

inferred← citeshttps://doi.org/10.1002/ange.201601803openalex-snapshot

Die Wassergas‐Shift‐Reaktion in der organischen Synthese

inferred← citeshttps://doi.org/10.1002/ange.201811627openalex-snapshot

Mechanism of the Water–Gas Shift Reaction Catalyzed by Efficient Ruthenium‐Based Catalysts: A Computational and Experimental Study

inferred← citeshttps://doi.org/10.1002/anie.201601803openalex-snapshot

Harnessing the Power of the Water‐Gas Shift Reaction for Organic Synthesis

inferred← citeshttps://doi.org/10.1002/anie.201811627openalex-snapshot

Mechanism of the Water–Gas Shift Reaction Catalyzed by Efficient Ruthenium‐Based Catalysts: A Computational and Experimental Study

inferred← citeshttps://doi.org/10.1002/cssc.201903417openalex-snapshot

Catalytic Semi‐Water–Gas Shift Reaction: A Simple Green Path to Formic Acid Fuel

inferred← citeshttps://doi.org/10.1002/cvde.200804265openalex-snapshot

Improving Purity and Size Control of Iron‐ and Molybdenum‐Supported Nanoparticles Prepared by OMCVD from their Carbonyl Precursors

inferred← citeshttps://doi.org/10.1002/jcc.1122openalex-snapshot

Parametrization of the Becke3‐LYP hybrid functional for a series of small molecules using quantum molecular similarity techniques

inferred← citeshttps://doi.org/10.1007/0-306-47597-9_9openalex-snapshot

Reactions and Acidity of Dihydrogen Complexes

inferred← citeshttps://doi.org/10.1007/978-3-322-99393-9_18openalex-snapshot

Organometallkatalyse in Synthese und Produktion

inferred← citeshttps://doi.org/10.1007/s00894-018-3915-1openalex-snapshot

Formation of metallacarboxylic acids through Hieber base reaction. A density functional theory study

inferred← citeshttps://doi.org/10.1007/s10563-016-9212-zopenalex-snapshot

Theoretical Study of the Water-Gas Shift Reaction Catalyzed by Tungsten Carbonyls

inferred← citeshttps://doi.org/10.1007/s10876-017-1231-zopenalex-snapshot

Mechanisms of the Water–Gas Shift Reaction Catalyzed by Carbonyl Complexes Mo(CO)6 and Mo2(CO)10: A Density Functional Theory Study

inferred← citeshttps://doi.org/10.1007/s11051-019-4558-6openalex-snapshot

Reaction kinetics and temperature effects in syngas photo-initiated chemical vapor deposition on single-walled carbon nanotubes

inferred← citeshttps://doi.org/10.1016/b0-08-045047-4/00080-7openalex-snapshot

Mononuclear Iron Carbonyls without Hydrocarbon Ligands

inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.03894-4openalex-snapshot

Mononuclear Iron Carbonyls without Hydrocarbon Ligands

inferred← citeshttps://doi.org/10.1016/j.comptc.2015.04.004openalex-snapshot

DFT/QTAIM analysis of the effect of late transition metal doping on methane selectivity in Fischer–Tröpsch catalysis

inferred← citeshttps://doi.org/10.1016/j.ijhydene.2015.11.108openalex-snapshot

Mechanisms of the water–gas shift reaction catalyzed by carbonyl complexes M(CO) 6 (M = Mo, W)

inferred← citeshttps://doi.org/10.1016/j.ijhydene.2024.05.025openalex-snapshot

Density functional theory study on the mechanism of water gas shift reaction catalyzed by molybdenum hexacarbonyl in aqueous solvent

inferred← citeshttps://doi.org/10.1016/j.jorganchem.2008.09.022openalex-snapshot

On the role of the indenyl effect in controlling intramolecular hydride transfer in iron carbonyl complexes

inferred← citeshttps://doi.org/10.1016/j.jorganchem.2022.122355openalex-snapshot

A perspective on exploration of synthetic reaction pathways of stable metallocarboxylic acids and structural features of MCOOH moiety

inferred← citeshttps://doi.org/10.1016/j.mcat.2024.114054openalex-snapshot

Density functional theory study of Fe(CO)5 and [Fe(CO)6]2+ complexes catalyzed the water gas shift reaction extended to the aqueous phase

inferred← citeshttps://doi.org/10.1016/j.molcata.2005.09.004openalex-snapshot

Reductive N-acylation of nitroarenes by Fe3+-montmorillonite

inferred← citeshttps://doi.org/10.1016/j.theochem.2006.04.039openalex-snapshot

Bonding and solvation preferences of nickel complexes [Ni(S2PR2)2] (R=H, Me, OMe) according a natural bond orbital analysis

inferred← citeshttps://doi.org/10.1016/s0010-8545(00)00293-9openalex-snapshot

Application of transition metals in hydroformylation. Annual survey covering the year 1999

inferred← citeshttps://doi.org/10.1016/s1380-7323(02)80015-2openalex-snapshot

VB analysis of wavefunctions calculated for chemical reactions in solution

inferred← citeshttps://doi.org/10.1021/acs.inorgchem.9b02400openalex-snapshot

Selective Oxidation of H 2 and CO by NiIr Catalyst in Aqueous Solution: A DFT Mechanistic Study

inferred← citeshttps://doi.org/10.1021/acs.jpca.6b00301openalex-snapshot

Mechanisms of the Water–Gas Shift Reaction Catalyzed by Ruthenium Carbonyl Complexes

inferred← citeshttps://doi.org/10.1021/cr980452iopenalex-snapshot

Theoretical Studies of Some Transition-Metal-Mediated Reactions of Industrial and Synthetic Importance

inferred← citeshttps://doi.org/10.1021/cs400809kopenalex-snapshot

Reverse Water-Gas Shift Reaction Catalyzed by Mononuclear Ru Complexes

inferred← citeshttps://doi.org/10.1021/ic0006089openalex-snapshot

Intramolecular Rearrangements in Six-Coordinate Ruthenium and Iron Dihydrides

inferred← citeshttps://doi.org/10.1021/ic049159topenalex-snapshot

Theoretical Study of the Gas-Phase Fe(CO)5 Catalyzed Water Gas Shift Reaction: A New Mechanism Proposed

inferred← citeshttps://doi.org/10.1021/ic201788topenalex-snapshot

A Theoretical Study of Metal–Metal Cooperativity in the Homogeneous Water Gas Shift Reaction

inferred← citeshttps://doi.org/10.1021/ic301539qopenalex-snapshot

Mechanisms of the Water-Gas Shift Reaction Catalyzed by Ruthenium Pentacarbonyl: A Density Functional Theory Study

inferred← citeshttps://doi.org/10.1021/ic5021127openalex-snapshot

Theoretical Study on the Mechanism of Aqueous Synthesis of Formic Acid Catalyzed by [Ru3+]-EDTA Complex

inferred← citeshttps://doi.org/10.1021/ic8001866openalex-snapshot

Mechanisms of the Water−Gas-Shift Reaction by Iron Pentacarbonyl in the Gas Phase

inferred← citeshttps://doi.org/10.1021/ie020185dopenalex-snapshot

Spectroscopy of Hydrothermal Reactions 21. Decomposition Reactions and Kinetics of Ni(CO)4, Co(CO)4- and (η5-C5H5)Co(CO)2 in High Temperature Water

inferred← citeshttps://doi.org/10.1021/jp204776aopenalex-snapshot

Theoretical Investigation of Water Gas Shift Reaction Catalyzed by Iron Group Carbonyl Complexes M(CO)5(M = Fe, Ru, Os)

inferred← citeshttps://doi.org/10.1021/jp406878kopenalex-snapshot

Mechanism of Iron Carbonyl-Catalyzed Hydrogenation of Ethylene. 1. Theoretical Exploration of Molecular Pathways

inferred← citeshttps://doi.org/10.1021/om000854sopenalex-snapshot

Theoretical Study of the Proton Transfer between Water and [FeH(CO)4]- in Aqueous Solution and Relevance to the Water-Gas Shift Reaction Catalyzed by Iron Pentacarbonyl in the Condensed Phase

inferred← citeshttps://doi.org/10.1021/om020551topenalex-snapshot

Nature of the Transition-Metal−η2-H2 Bond in TM(CO)3X2(η2-H2) (TM = Cr, Mo, W; X = CO, PH3, PCl3, PMe3) Complexes

inferred← citeshttps://doi.org/10.1021/om0504147openalex-snapshot

Aqueous Transformation of a Metal Diformate to a Metal Dihydride Carbonyl Complex Accompanied by H2 Evolution from the Formato Ligands

inferred← citeshttps://doi.org/10.1039/b303239fopenalex-snapshot

The electronic spectroscopy of transition metal di-hydrides H 2 M(CO) 4 (M = Fe,Os): a theoretical study based on CASSCF/MS-CASPT2 and TD-DFT

inferred← citeshttps://doi.org/10.1039/b601305hopenalex-snapshot

Low temperature water-gas shift catalysts

inferred← citeshttps://doi.org/10.1039/b917156hopenalex-snapshot

Synthesis of transition metal isocyanide compounds from carbonyl complexes via reaction with Li[Me3SiNR]

inferred← citeshttps://doi.org/10.1039/c4dt02966fopenalex-snapshot

A contribution to the rational design of Ru(CO) 3 Cl 2 L complexes for in vivo delivery of CO

inferred← citeshttps://doi.org/10.1039/c6dt02759hopenalex-snapshot

Novel synthesis of a four-electron-reduced ruthenium( ii ) NADH-type complex under water-gas-shift reaction conditions

inferred← citeshttps://doi.org/10.1039/c6dt04659bopenalex-snapshot

β-Diketiminate calcium hydride complexes: the importance of solvent effects

inferred← citeshttps://doi.org/10.1039/c7sc00703eopenalex-snapshot

Revisiting the polytopal rearrangements in penta-coordinate d 7 -metallocomplexes: modified Berry pseudorotation, octahedral switch, and butterfly isomerization

inferred← citeshttps://doi.org/10.1039/d1cy00695aopenalex-snapshot

Carbon monoxide-driven osmium catalyzed reductive amination harvesting WGSR power

inferred← citeshttps://doi.org/10.1039/d4nj03139copenalex-snapshot

A density functional theory study of the water–gas shift reaction catalyzed by a Cr(CO) 6 complex

inferred← citeshttps://doi.org/10.1134/s207020511704013xopenalex-snapshot

Theoretical investigation of water gas shift reaction catalyzed by [Ru(CO)3Cl3]– in solution

inferred← citeshttps://doi.org/10.2514/6.2014-0340openalex-snapshot

Production of Aerospace Fuels from Non-Petroleum Raw Materials: Technical Challenges and Technology Opportunities

Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.